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Name | CHEMBL266619 |
---|---|
Molecular formula | C13H21NO4 |
IUPAC name | 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzene-1,2-diol |
Molecular weight | 255.314 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 4 |
XlogP | 1.1 |
Synonyms | DTXSID60339904 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzene-1,2-diol AC1LBLAW 1,2-Benzenediol, 4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]- 4-(3-tert-Butylamino-2-hydroxypropyloxy)benzene-1,2-diol [ Show all ] |
Inchi Key | GWXLUBAMOLHDHG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C13H21NO4/c1-13(2,3)14-7-9(15)8-18-10-4-5-11(16)12(17)6-10/h4-6,9,14-17H,7-8H2,1-3H3 |
PubChem CID | 559926 |
ChEMBL | CHEMBL266619 |
IUPHAR | N/A |
BindingDB | 50007476 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
107343 | Beta-1 adrenergic receptor | P18090 | Adrb1 | Rattus norvegicus (Rat) | 466 |
107344 | Beta-2 adrenergic receptor | Q8K4Z4 | Adrb2 | Cavia porcellus (Guinea pig) | 418 |
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